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629-15-2

乙二醇二甲酸酯(629-15-2)核磁图(13CNMR)

产品名称:乙二醇二甲酸酯

CAS:629-15-2

分子式:C4H6O4

分子量: 118.09

InChI:InChI=1S/C4H6O4/c5-3-7-1-2-8-4-6/h3-4H,1-2H2

InChIKey: IKCQWKJZLSDDSS-UHFFFAOYSA-N

Smiles:C(OC=O)COC=O

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    Mass

    MS-IW-3812          
    ethylene diformate
    C4H6O4              (Mass of molecular ion:    118)
    

       Source Temperature: 220 °C
       Sample Temperature: 150 °C
       Reservoir, 75 eV
    

          14.0       1.1
          15.0       6.6
          19.0       3.8
          26.0       3.1
          27.0      14.0
          28.0       7.7
          29.0      41.0
          30.0       3.8
          31.0      83.3
          32.0      21.6
          33.0       2.0
          42.0       4.4
          43.0      35.6
          44.0      86.6
          45.0      16.3
          46.0       1.4
          47.0       9.4
          59.0       1.3
          60.0     100.0
          61.0       6.6
          72.0      14.7
          73.0       8.2
    

parameter in CDCl3

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    1H NMR 300 MHz
    C4 H6 O4 0.05 ml : 0.5 ml CDCl3
    ethylene diformate
    ChemicalStructure
        Parameter     ppm  Hz
    D(A) 8.102 D(B) 4.420

         Hz     ppm     Int.
    

       2430.60   8.102    500
       1326.00   4.420   1000
    

in CDCl3

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liquid film

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